methyl 2-[(E)-3-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]prop-2-enoyl]benzoate

Systemtic Name: methyl 2-[(E)-3-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]prop-2-enoyl]benzoate Openeye Name: methyl 2-[(E)-3-[4-(thiazol-2-ylcarbamoyl)phenyl]prop-2-enoyl]benzoate CAS Name: 2-[(E)-1-oxo-3-[4-[oxo-(2-thiazolylamino)methyl]phenyl]prop-2-enyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(E)-3-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]prop-2-enoyl]benzoate Traditional Name: 2-[(E)-3-[4-(thiazol-2-ylcarbamoyl)phenyl]acryloyl]benzoic acid methyl ester Formula: C21H16N2O4S MolecularWeight: 392.42774

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C(=O)C=CC2=CC=C(C=C2)C(=O)NC3=NC=CS3

Isomeric SMILES

COC(=O)C1=CC=CC=C1C(=O)/C=C/C2=CC=C(C=C2)C(=O)NC3=NC=CS3

InChI

InChI=1S/C21H16N2O4S/c1-27-20(26)17-5-3-2-4-16(17)18(24)11-8-14-6-9-15(10-7-14)19(25)23-21-22-12-13-28-21/h2-13H,1H3,(H,22,23,25)/b11-8+